ethyl 3-[5-(4-chlorophenyl)-1-(4-methoxyphenyl)pyrazol-3-yl]-2-phenyl-propanoate

Systemtic Name: ethyl 3-[5-(4-chlorophenyl)-1-(4-methoxyphenyl)pyrazol-3-yl]-2-phenyl-propanoate Openeye Name: ethyl 3-[5-(4-chlorophenyl)-1-(4-methoxyphenyl)pyrazol-3-yl]-2-phenyl-propanoate CAS Name: 3-[5-(4-chlorophenyl)-1-(4-methoxyphenyl)-3-pyrazolyl]-2-phenylpropanoic acid ethyl ester IUPAC Name: ethyl 3-[5-(4-chlorophenyl)-1-(4-methoxyphenyl)pyrazol-3-yl]-2-phenylpropanoate Traditional Name: 3-[5-(4-chlorophenyl)-1-(4-methoxyphenyl)pyrazol-3-yl]-2-phenyl-propionic acid ethyl ester Formula: C27H25ClN2O3 MolecularWeight: 460.952

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=NN(C(=C1)C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)OC)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C(CC1=NN(C(=C1)C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)OC)C4=CC=CC=C4

InChI

InChI=1S/C27H25ClN2O3/c1-3-33-27(31)25(19-7-5-4-6-8-19)17-22-18-26(20-9-11-21(28)12-10-20)30(29-22)23-13-15-24(32-2)16-14-23/h4-16,18,25H,3,17H2,1-2H3